5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine

C20H21N5 — CID 44547515

IUPAC5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1cc(C)n2nc(CCc3nc(-c4ccccc4)cn3C)nc2c1
InChIInChI=1S/C20H21N5/c1-14-11-15(2)25-20(12-14)22-18(23-25)9-10-19-21-17(13-24(19)3)16-7-5-4-6-8-16/h4-8,11-13H,9-10H2,1-3H3
InChIKeyXMPIBGQRSIGLJS-UHFFFAOYSA-N
MW331.42 g/mol
LogP3.53
Rot. Bonds4

About 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine

5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 44547515) has the molecular formula C20H21N5 and a molecular weight of 331.42 g/mol. Its IUPAC name is 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID44547515
Molecular FormulaC20H21N5
Molecular Weight331.42 g/mol
Exact Mass331.18
IUPAC Name5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1cc(C)n2nc(CCc3nc(-c4ccccc4)cn3C)nc2c1
InChIInChI=1S/C20H21N5/c1-14-11-15(2)25-20(12-14)22-18(23-25)9-10-19-21-17(13-24(19)3)16-7-5-4-6-8-16/h4-8,11-13H,9-10H2,1-3H3
InChIKeyXMPIBGQRSIGLJS-UHFFFAOYSA-N
XLogP3.53
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Related Compounds

2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
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Pf-05180999
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Forasartan
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Adipiplon
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L-158809
CID 183134
2-(Hydroxyamino)-1-methyl-6-phenylimidazo(4,5-b)pyridine
CID 104954
R121919
CID 9821250
3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine
CID 70588
6-Methyl-2-(4-methylphenyl)imidazo(1,2-a)pyridine
CID 667720

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 44547515) is 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine is Cc1cc(C)n2nc(CCc3nc(-c4ccccc4)cn3C)nc2c1.
What is the InChIKey of 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is XMPIBGQRSIGLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5/c1-14-11-15(2)25-20(12-14)22-18(23-25)9-10-19-21-17(13-24(19)3)16-7-5-4-6-8-16/h4-8,11-13H,9-10H2,1-3H3.
What are the key properties of 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 331.42 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 44547515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).